Information card for entry 7232589

Structure parameters

• Formula: C19 H10 F6 Fe N4 O5
• Calculated formula: C19 H8 F6 Fe N4 O5
• Title of publication: 6,6′-(Perfluoropropane-2,2-diyl)bis(2,3-dihydrophthalazine-1,4-dione)-based coordination polymers and their sensing properties towards Cr2O72−
• Authors of publication: Wan, Ke-Ke; Yu, Jie-Hui; Xu, Ji-Qing
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 19
• Pages of publication: 3086
• a: 36.5822 ± 0.0012 Å
• b: 7.4122 ± 0.0002 Å
• c: 14.3145 ± 0.0005 Å
• α: 90°
• β: 101.916 ± 0.002°
• γ: 90°
• Cell volume: 3797.8 ± 0.2 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No